5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one

C10H11N3OS — CID 71046830

IUPAC5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one
SMILESCCNc1c[nH]c(=O)c(-c2cncs2)c1
InChIInChI=1S/C10H11N3OS/c1-2-12-7-3-8(10(14)13-4-7)9-5-11-6-15-9/h3-6,12H,2H2,1H3,(H,13,14)
InChIKeyZHAFLUJDBPGAPL-UHFFFAOYSA-N
MW221.28 g/mol
LogP1.93
Rot. Bonds3

About 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one

5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one (PubChem CID 71046830) has the molecular formula C10H11N3OS and a molecular weight of 221.28 g/mol. Its IUPAC name is 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one
PubChem CID71046830
Molecular FormulaC10H11N3OS
Molecular Weight221.28 g/mol
Exact Mass221.06
IUPAC Name5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one
SMILESCCNc1c[nH]c(=O)c(-c2cncs2)c1
InChIInChI=1S/C10H11N3OS/c1-2-12-7-3-8(10(14)13-4-7)9-5-11-6-15-9/h3-6,12H,2H2,1H3,(H,13,14)
InChIKeyZHAFLUJDBPGAPL-UHFFFAOYSA-N
XLogP1.93
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one?
The IUPAC name of 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one (CID 71046830) is 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one.
What is the SMILES notation for 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one?
The canonical SMILES for 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one is CCNc1c[nH]c(=O)c(-c2cncs2)c1.
What is the InChIKey of 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one?
The InChIKey is ZHAFLUJDBPGAPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-2-12-7-3-8(10(14)13-4-7)9-5-11-6-15-9/h3-6,12H,2H2,1H3,(H,13,14).
What are the key properties of 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one?
5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one has a molecular weight of 221.28 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one is sourced from PubChem (CID 71046830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).